4-[4-[(3R)-3-(3-methylphenyl)piperidin-1-ium-1-yl]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[4-[(3R)-3-(3-methylphenyl)piperidin-1-ium-1-yl]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[4-[(3R)-3-(m-tolyl)piperidin-1-ium-1-yl]-1-piperidyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[4-[(3R)-3-(3-methylphenyl)-1-piperidin-1-iumyl]-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[4-[(3R)-3-(3-methylphenyl)piperidin-1-ium-1-yl]piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[4-[(3R)-3-(m-tolyl)piperidin-1-ium-1-yl]piperidino]-N-(3-pyridylmethyl)benzamide Formula: C30H37N4O+ MolecularWeight: 469.64098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCC[NH+](C2)C3CCN(CC3)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2CCC[NH+](C2)C3CCN(CC3)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C30H36N4O/c1-23-5-2-7-26(19-23)27-8-4-16-34(22-27)29-13-17-33(18-14-29)28-11-9-25(10-12-28)30(35)32-21-24-6-3-15-31-20-24/h2-3,5-7,9-12,15,19-20,27,29H,4,8,13-14,16-18,21-22H2,1H3,(H,32,35)/p+1/t27-/m0/s1